N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine

C9H19FN2 — CID 143531794

IUPACN'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine
SMILESCCN(CCN(C)C)/C(C)=C\F
InChIInChI=1S/C9H19FN2/c1-5-12(9(2)8-10)7-6-11(3)4/h8H,5-7H2,1-4H3/b9-8-
InChIKeySQIOMVNEJZZIKS-HJWRWDBZSA-N
MW174.26 g/mol
LogP1.70
Rot. Bonds5

About N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine

N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine (PubChem CID 143531794) has the molecular formula C9H19FN2 and a molecular weight of 174.26 g/mol. Its IUPAC name is N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine
PubChem CID143531794
Molecular FormulaC9H19FN2
Molecular Weight174.26 g/mol
Exact Mass174.15
IUPAC NameN'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine
SMILESCCN(CCN(C)C)/C(C)=C\F
InChIInChI=1S/C9H19FN2/c1-5-12(9(2)8-10)7-6-11(3)4/h8H,5-7H2,1-4H3/b9-8-
InChIKeySQIOMVNEJZZIKS-HJWRWDBZSA-N
XLogP1.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine (CID 143531794) is N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine is CCN(CCN(C)C)/C(C)=C\F.
What is the InChIKey of N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine?
The InChIKey is SQIOMVNEJZZIKS-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H19FN2/c1-5-12(9(2)8-10)7-6-11(3)4/h8H,5-7H2,1-4H3/b9-8-.
What are the key properties of N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine?
N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine has a molecular weight of 174.26 g/mol, XLogP of 1.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-[(Z)-1-fluoroprop-1-en-2-yl]-N,N-dimethylethane-1,2-diamine is sourced from PubChem (CID 143531794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).